0  B7R0.1  N#CCCNCCO BBC/757 [0,0,0,0,0,0|2,0,1]=3
1  B7R0.1  NCCSSCCN BBC/119 [0,0,0,0,0,0|4,0,0]=4
2  B6R0.6  CCNCCCN BBC/176 [1,0,0,0,0,0|2,0,0]=3
3  B6R0.6  CCOCCNC BBC/039 [1,0,0,0,0,0|2,0,0]=3
4  B8R0.4  COCCNCCC#N BBC/746 [0,1,0,0,0,0|2,0,1]=4
5  B8R0.4  COCCNCCCN BBC/558 [0,1,0,0,0,0|2,0,0]=3
6  B8R0.4  N#CCCNCCCO BBC/019 [0,1,0,0,0,0|1,0,1]=3
7  B8R0.4  NCCCNCCCO BBC/041 [0,1,0,0,0,0|1,0,0]=2
8  B8R0.6  CCC(C)NCCC#N BBC/699 [0,1,0,0,0,0|2,0,1]=4
9  B8R0.6  CCCCCC(=O)NN BBB/658 [0,1,0,0,0,0|2,0,1]=4
10  B8R0.7  CCCNCCC(N)=O BBC/745 [0,1,0,0,0,0|1,0,2]=4
11  B8R0.7  NC(=O)CCNCCO BBC/748 [0,1,0,0,0,0|2,0,1]=4
12  B8R0.7  O=C(O)CCCCCBr BBB/450 [0,1,0,0,0,0|1,0,1]=3
13  B8R1.2  O=CN1CCCCC1 BBC/227 [0,0,0,1,0,0|1,0,2]=4
14  B8R1.8  CCNC1CCCC1 BBB/781 [0,0,0,1,0,0|2,0,0]=3
15  B8R1.8  N#CCC1CCCC1 BBC/280 [0,0,0,1,0,0|1,0,1]=3
16  B5R0.2  CC\C=C\CC BBC/270 [2,0,0,0,0,0|0,0,2]=4
17  B5R0.2  CNCCOC BBB/960 [2,0,0,0,0,0|2,0,0]=4
18  B7R0.3  CCC(Cl)CCCCl BBC/272 [1,1,0,0,0,0|1,0,0]=3
19  B7R0.4  CC(C)OCCCO BBB/1011 [1,1,0,0,0,0|1,0,0]=3
20  B7R0.7  CCOC(C)CNC BBB/937 [1,1,0,0,0,0|2,0,0]=4
21  B9R0.2  COCCCCCC(=O)O BBC/051 [0,2,0,0,0,0|0,0,1]=3
22  B9R0.2  NC(=O)CCNCCCO BBC/043 [0,2,0,0,0,0|1,0,1]=4
23  B9R1.8  CCOC1CCNCC1 BBB/910 [0,1,0,1,0,0|2,0,0]=4
24  B9R1.12  CCCNC1CCCC1 BBB/464 [0,1,0,1,0,0|1,0,0]=3
25  B9R1.12  CCNCC1CCCO1 BBB/426 [0,1,0,1,0,0|0,0,0]=2
26  B9R1.83  COCCNCC1CC1 BBB/901 [0,1,0,1,0,0|1,0,0]=3
27  B9R1.89  COC1=NCCCCC1 BBC/134 [0,1,0,1,0,0|1,0,1]=4
28  B9R1.21  CCN1CCC(CO)C1 BBB/884 [0,1,0,1,0,0|1,0,0]=3
29  B9R1.13  O=C(Cl)CC1CCCC1 BBC/618 [0,1,0,1,0,0|0,0,2]=4
30  B9R1.13  O=C(O)CC1CCCC1 BBC/406 [0,1,0,1,0,0|0,0,1]=3